N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine

C11H15N3 — CID 90287555

IUPACN-methyl-N-propan-2-yl-1H-benzimidazol-2-amine
SMILESCC(C)N(C)c1nc2ccccc2[nH]1
InChIInChI=1S/C11H15N3/c1-8(2)14(3)11-12-9-6-4-5-7-10(9)13-11/h4-8H,1-3H3,(H,12,13)
InChIKeyVHDFOMIFKNOWNN-UHFFFAOYSA-N
MW189.26 g/mol
LogP2.41
Rot. Bonds2

About N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine

N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine (PubChem CID 90287555) has the molecular formula C11H15N3 and a molecular weight of 189.26 g/mol. Its IUPAC name is N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine.

Molecular Properties

Compound NameN-methyl-N-propan-2-yl-1H-benzimidazol-2-amine
PubChem CID90287555
Molecular FormulaC11H15N3
Molecular Weight189.26 g/mol
Exact Mass189.13
IUPAC NameN-methyl-N-propan-2-yl-1H-benzimidazol-2-amine
SMILESCC(C)N(C)c1nc2ccccc2[nH]1
InChIInChI=1S/C11H15N3/c1-8(2)14(3)11-12-9-6-4-5-7-10(9)13-11/h4-8H,1-3H3,(H,12,13)
InChIKeyVHDFOMIFKNOWNN-UHFFFAOYSA-N
XLogP2.41
TPSA31.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500189.26
LogP ≤ 52.41
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

N,N-dimethyl-1H-benzimidazol-2-amine
CID 17846
2-[1H-benzimidazol-2-yl(propan-2-yl)amino]ethanol
CID 60724199
N-[1-(2-fluorophenyl)ethyl]-N-methyl-1H-benzimidazol-2-amine
CID 133409745
N-(2-chloropropyl)-N-methyl-1H-benzimidazol-2-amine
CID 63392162
N-cyclobutyl-N-methyl-1H-benzimidazol-2-amine
CID 115143834
N-butyl-N-methyl-1H-benzimidazol-2-amine
CID 71723451
N-(2-methoxyethyl)-N-methyl-1H-benzimidazol-2-amine
CID 133409792
5-[1H-benzimidazol-2-yl(methyl)amino]pentan-1-ol
CID 107203344
CID 101039162
CID 101039162
2-propan-2-yl-1H-benzimidazole
CID 22121
methyl N-(1H-benzimidazol-2-yl)-N-methylcarbamate
CID 69230726
N-(2-methoxyphenyl)-N-methyl-1H-benzimidazol-2-amine
CID 115143824

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine?
The IUPAC name of N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine (CID 90287555) is N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine.
What is the SMILES notation for N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine?
The canonical SMILES for N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine is CC(C)N(C)c1nc2ccccc2[nH]1.
What is the InChIKey of N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine?
The InChIKey is VHDFOMIFKNOWNN-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H15N3/c1-8(2)14(3)11-12-9-6-4-5-7-10(9)13-11/h4-8H,1-3H3,(H,12,13).
What are the key properties of N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine?
N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine has a molecular weight of 189.26 g/mol, XLogP of 2.41, 2 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-propan-2-yl-1H-benzimidazol-2-amine is sourced from PubChem (CID 90287555), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).